all_aminont94_dat = {
"TYR": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0102, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0102, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O'], ['CG', 'CE2', 'CD2', 'HD2'], ['CD2', 'CZ', 'CE2', 'HE2'], ['CD1', 'CZ', 'CE1', 'HE1'], ['CG', 'CE1', 'CD1', 'HD1'], ['CD1', 'CD2', 'CG', 'CB'], ['CE1', 'CE2', 'CZ', 'OH']],
	"INTX,KFORM":['INT', '1'],
	"HD2":{'torsion': 180.0, 'tree': 'E', 'NC': 18, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 120.0, 'blen': 1.09, 'charge': 0.172, 'type': 'HA'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1873, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1873, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1873, 'type': 'H'},
	"OH":{'torsion': 180.0, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 18, 'I': 19, 'angle': 120.0, 'blen': 1.36, 'charge': -0.5578, 'type': 'OH'},
	"HD1":{'torsion': 0.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 120.0, 'blen': 1.09, 'charge': 0.172, 'type': 'HA'},
	"HE1":{'torsion': 180.0, 'tree': 'E', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 120.0, 'blen': 1.09, 'charge': 0.165, 'type': 'HA'},
	"HE2":{'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 18, 'NA': 21, 'I': 22, 'angle': 120.0, 'blen': 1.09, 'charge': 0.165, 'type': 'HA'},
	"CD2":{'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 18, 'NA': 21, 'I': 23, 'angle': 120.0, 'blen': 1.4, 'charge': -0.2002, 'type': 'CA'},
	"NAMRES":'TYROSINE',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'CD1', 'HD1', 'CE1', 'HE1', 'CZ', 'OH', 'HH', 'CE2', 'HE2', 'CD2', 'HD2', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"CE1":{'torsion': 180.0, 'tree': 'B', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 120.0, 'blen': 1.4, 'charge': -0.2239, 'type': 'CA'},
	"CD1":{'torsion': 180.0, 'tree': 'B', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 120.0, 'blen': 1.4, 'charge': -0.2002, 'type': 'CA'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0983, 'type': 'HP'},
	"HH":{'torsion': 0.0, 'tree': 'E', 'NC': 16, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 113.0, 'blen': 0.96, 'charge': 0.4001, 'type': 'HO'},
	"CZ":{'torsion': 0.0, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 18, 'angle': 120.0, 'blen': 1.4, 'charge': 0.3139, 'type': 'C'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.194, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 25, 'I': 26, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': 'S', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.47, 'blen': 1.51, 'charge': -0.0205, 'type': 'CA'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.057, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0659, 'type': 'CT'},
	"CE2":{'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 18, 'I': 21, 'angle': 120.0, 'blen': 1.4, 'charge': -0.2239, 'type': 'CA'},
	"loopList":[['CG', 'CD2']],
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 25, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
},
"ASN": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0515, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0515, 'type': 'HC'},
	"ND2":{'torsion': 180.0, 'tree': 'B', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 15, 'angle': 116.6, 'blen': 1.335, 'charge': -0.8634, 'type': 'N'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O'], ['CB', 'ND2', 'CG', 'OD1'], ['CG', 'HD21', 'ND2', 'HD22']],
	"INTX,KFORM":['INT', '1'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1921, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1921, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1921, 'type': 'H'},
	"NAMRES":'ASPARAGINE',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'OD1', 'ND2', 'HD21', 'HD22', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1231, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1801, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 18, 'I': 19, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5722, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': 'B', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 111.1, 'blen': 1.522, 'charge': 0.5833, 'type': 'C'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0368, 'type': 'CT'},
	"OD1":{'torsion': 0.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5744, 'type': 'O'},
	"HD21":{'torsion': 180.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 15, 'I': 16, 'angle': 119.8, 'blen': 1.01, 'charge': 0.4097, 'type': 'H'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': -0.0283, 'type': 'CT'},
	"HD22":{'torsion': 0.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 15, 'I': 17, 'angle': 119.8, 'blen': 1.01, 'charge': 0.4097, 'type': 'H'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 18, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6163, 'type': 'C'},
},
"CYS": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1188, 'type': 'H1'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1188, 'type': 'H1'},
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'SG', 'HSG', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"SG":{'torsion': 180.0, 'tree': 'S', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 116.0, 'blen': 1.81, 'charge': -0.3298, 'type': 'SH'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 15, 'I': 16, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1411, 'type': 'HP'},
	"impropTors":[['CA', '+M', 'C', 'O']],
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2023, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1325, 'type': 'N3'},
	"INTX,KFORM":['INT', '1'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.2023, 'type': 'H'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0927, 'type': 'CT'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2023, 'type': 'H'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': -0.1195, 'type': 'CT'},
	"HSG":{'torsion': 180.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 96.0, 'blen': 1.33, 'charge': 0.1975, 'type': 'HS'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 15, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
	"NAMRES":'CYSTEINE',
},
"ARG": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0226, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0226, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O'], ['NE', 'NH1', 'CZ', 'NH2'], ['CD', 'CZ', 'NE', 'HE'], ['CZ', 'HH11', 'NH1', 'HH12'], ['CZ', 'HH21', 'NH2', 'HH22']],
	"HH11":{'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 23, 'angle': 119.8, 'blen': 1.01, 'charge': 0.4494, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2083, 'type': 'H'},
	"HH21":{'torsion': 0.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 25, 'I': 26, 'angle': 119.8, 'blen': 1.01, 'charge': 0.4494, 'type': 'H'},
	"HH22":{'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 25, 'I': 27, 'angle': 119.8, 'blen': 1.01, 'charge': 0.4494, 'type': 'H'},
	"INTX,KFORM":['INT', '1'],
	"NE":{'torsion': 180.0, 'tree': 'B', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 19, 'angle': 111.0, 'blen': 1.48, 'charge': -0.565, 'type': 'N2'},
	"HG2":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0309, 'type': 'HC'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.2083, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1305, 'type': 'N3'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2083, 'type': 'H'},
	"HD2":{'torsion': 300.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 17, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0527, 'type': 'H1'},
	"HD3":{'torsion': 60.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 18, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0527, 'type': 'H1'},
	"NAMRES":'ARGININE',
	"HE":{'torsion': 0.0, 'tree': 'E', 'NC': 13, 'NB': 16, 'NA': 19, 'I': 20, 'angle': 118.5, 'blen': 1.01, 'charge': 0.3592, 'type': 'H'},
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'HG2', 'HG3', 'CD', 'HD2', 'HD3', 'NE', 'HE', 'CZ', 'NH1', 'HH11', 'HH12', 'NH2', 'HH21', 'HH22', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"NH2":{'torsion': 180.0, 'tree': 'B', 'NC': 16, 'NB': 19, 'NA': 21, 'I': 25, 'angle': 118.0, 'blen': 1.33, 'charge': -0.8693, 'type': 'N2'},
	"HG3":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 15, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0309, 'type': 'HC'},
	"NH1":{'torsion': 0.0, 'tree': 'B', 'NC': 16, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 122.0, 'blen': 1.33, 'charge': -0.8693, 'type': 'N2'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1242, 'type': 'HP'},
	"CZ":{'torsion': 180.0, 'tree': 'B', 'NC': 13, 'NB': 16, 'NA': 19, 'I': 21, 'angle': 123.0, 'blen': 1.33, 'charge': 0.8281, 'type': 'CA'},
	"CD":{'torsion': 180.0, 'tree': '3', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 16, 'angle': 109.47, 'blen': 1.525, 'charge': 0.0935, 'type': 'CT'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 28, 'I': 29, 'angle': 120.5, 'blen': 1.229, 'charge': -0.6013, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.47, 'blen': 1.525, 'charge': 0.0236, 'type': 'CT'},
	"HH12":{'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 22, 'I': 24, 'angle': 119.8, 'blen': 1.01, 'charge': 0.4494, 'type': 'H'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': -0.0223, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0118, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 28, 'angle': 111.1, 'blen': 1.522, 'charge': 0.7214, 'type': 'C'},
},
"LEU": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0256, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0256, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O']],
	"INTX,KFORM":['INT', '1'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.2148, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2148, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2148, 'type': 'H'},
	"NAMRES":'LEUCINE',
	"HG":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': -0.038, 'type': 'HC'},
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'HG', 'CD1', 'HD11', 'HD12', 'HD13', 'CD2', 'HD21', 'HD22', 'HD23', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HD11":{'torsion': 60.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 15, 'I': 16, 'angle': 109.5, 'blen': 1.09, 'charge': 0.098, 'type': 'HC'},
	"HD12":{'torsion': 180.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 15, 'I': 17, 'angle': 109.5, 'blen': 1.09, 'charge': 0.098, 'type': 'HC'},
	"HD13":{'torsion': 300.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 15, 'I': 18, 'angle': 109.5, 'blen': 1.09, 'charge': 0.098, 'type': 'HC'},
	"CD2":{'torsion': 180.0, 'tree': '3', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 19, 'angle': 109.47, 'blen': 1.525, 'charge': -0.4104, 'type': 'CT'},
	"CD1":{'torsion': 60.0, 'tree': '3', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 15, 'angle': 109.47, 'blen': 1.525, 'charge': -0.4106, 'type': 'CT'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1053, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.101, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 23, 'I': 24, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.47, 'blen': 1.525, 'charge': 0.3421, 'type': 'CT'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0104, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': -0.0244, 'type': 'CT'},
	"HD21":{'torsion': 60.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 19, 'I': 20, 'angle': 109.5, 'blen': 1.09, 'charge': 0.098, 'type': 'HC'},
	"HD23":{'torsion': 300.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 19, 'I': 22, 'angle': 109.5, 'blen': 1.09, 'charge': 0.098, 'type': 'HC'},
	"HD22":{'torsion': 180.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 19, 'I': 21, 'angle': 109.5, 'blen': 1.09, 'charge': 0.098, 'type': 'HC'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 23, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
},
"HID": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0209, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0209, 'type': 'HC'},
	"NE2":{'torsion': 0.0, 'tree': 'S', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 18, 'angle': 109.0, 'blen': 1.31, 'charge': -0.5711, 'type': 'NB'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"ND1":{'torsion': 180.0, 'tree': 'B', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 122.0, 'blen': 1.39, 'charge': -0.3819, 'type': 'NA'},
	"impropTors":[['CA', '+M', 'C', 'O'], ['CG', 'CE1', 'ND1', 'HD1'], ['CG', 'NE2', 'CD2', 'HD2'], ['ND1', 'NE2', 'CE1', 'HE1'], ['ND1', 'CD2', 'CG', 'CB']],
	"CE1":{'torsion': 180.0, 'tree': 'B', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.0, 'blen': 1.32, 'charge': 0.2127, 'type': 'CR'},
	"INTX,KFORM":['INT', '1'],
	"HD2":{'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1299, 'type': 'H4'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1963, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1963, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1963, 'type': 'H'},
	"HD1":{'torsion': 0.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 126.0, 'blen': 1.01, 'charge': 0.3632, 'type': 'H'},
	"HE1":{'torsion': 180.0, 'tree': 'E', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1385, 'type': 'H5'},
	"NAMRES":'HISTIDINE DELTAH',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'ND1', 'HD1', 'CE1', 'HE1', 'NE2', 'CD2', 'HD2', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"CD2":{'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 18, 'I': 19, 'angle': 110.0, 'blen': 1.36, 'charge': 0.1046, 'type': 'CV'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0958, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1542, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 21, 'I': 22, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': 'S', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 115.0, 'blen': 1.51, 'charge': -0.0399, 'type': 'CC'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0964, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0259, 'type': 'CT'},
	"loopList":[['CG', 'CD2']],
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 21, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
},
"HIE": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0223, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0223, 'type': 'HC'},
	"NE2":{'torsion': 0.0, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 15, 'I': 17, 'angle': 109.0, 'blen': 1.31, 'charge': -0.2781, 'type': 'NA'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"ND1":{'torsion': 180.0, 'tree': 'S', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 122.0, 'blen': 1.39, 'charge': -0.5579, 'type': 'NB'},
	"impropTors":[['CA', '+M', 'C', 'O'], ['CE1', 'CD2', 'NE2', 'HE2'], ['CG', 'NE2', 'CD2', 'HD2'], ['ND1', 'NE2', 'CE1', 'HE1'], ['ND1', 'CD2', 'CG', 'CB']],
	"CE1":{'torsion': 180.0, 'tree': 'B', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 108.0, 'blen': 1.32, 'charge': 0.1804, 'type': 'CR'},
	"INTX,KFORM":['INT', '1'],
	"HD2":{'torsion': 180.0, 'tree': 'E', 'NC': 15, 'NB': 17, 'NA': 19, 'I': 20, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1963, 'type': 'H4'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.2016, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2016, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2016, 'type': 'H'},
	"HE2":{'torsion': 180.0, 'tree': 'E', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 18, 'angle': 125.0, 'blen': 1.01, 'charge': 0.3324, 'type': 'H'},
	"HE1":{'torsion': 180.0, 'tree': 'E', 'NC': 13, 'NB': 14, 'NA': 15, 'I': 16, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1397, 'type': 'H5'},
	"NAMRES":'HISTIDINE EPSILONH',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'ND1', 'CE1', 'HE1', 'NE2', 'HE2', 'CD2', 'HD2', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"CD2":{'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 15, 'NA': 17, 'I': 19, 'angle': 110.0, 'blen': 1.36, 'charge': -0.2349, 'type': 'CW'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.138, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1472, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 21, 'I': 22, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': 'S', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 115.0, 'blen': 1.51, 'charge': 0.174, 'type': 'CC'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0236, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0489, 'type': 'CT'},
	"loopList":[['CG', 'CD2']],
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 21, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
},
"MET": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0125, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0125, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 21, 'I': 22, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"impropTors":[['CA', '+M', 'C', 'O']],
	"SD":{'torsion': 180.0, 'tree': 'S', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 16, 'angle': 110.0, 'blen': 1.81, 'charge': -0.2774, 'type': 'S'},
	"INTX,KFORM":['INT', '1'],
	"HG3":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 15, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0292, 'type': 'H1'},
	"HG2":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0292, 'type': 'H1'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1984, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1984, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1984, 'type': 'H'},
	"HE3":{'torsion': 300.0, 'tree': 'E', 'NC': 13, 'NB': 16, 'NA': 17, 'I': 20, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0597, 'type': 'H1'},
	"HE2":{'torsion': 180.0, 'tree': 'E', 'NC': 13, 'NB': 16, 'NA': 17, 'I': 19, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0597, 'type': 'H1'},
	"HE1":{'torsion': 60.0, 'tree': 'E', 'NC': 13, 'NB': 16, 'NA': 17, 'I': 18, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0597, 'type': 'H1'},
	"NAMRES":'METHIONINE',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'HG2', 'HG3', 'SD', 'CE', 'HE1', 'HE2', 'HE3', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1116, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1592, 'type': 'N3'},
	"CE":{'torsion': 180.0, 'tree': '3', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 17, 'angle': 100.0, 'blen': 1.78, 'charge': -0.0341, 'type': 'CT'},
	"CG":{'torsion': 180.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.47, 'blen': 1.525, 'charge': 0.0334, 'type': 'CT'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0221, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0865, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 21, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
},
"IDBGEN,IREST,ITYPF":['1', '1', '200'],
"ALA": {	"HB2":{'torsion': 180.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.03, 'type': 'HC'},
	"HB3":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.5, 'blen': 1.09, 'charge': 0.03, 'type': 'HC'},
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB1', 'HB2', 'HB3', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HB1":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.03, 'type': 'HC'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 14, 'I': 15, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5722, 'type': 'O'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0889, 'type': 'HP'},
	"impropTors":[['CA', '+M', 'C', 'O']],
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1997, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1414, 'type': 'N3'},
	"INTX,KFORM":['INT', '1'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1997, 'type': 'H'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0962, 'type': 'CT'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1997, 'type': 'H'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': -0.0597, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 14, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6163, 'type': 'C'},
	"NAMRES":'ALANINE',
},
"PHE": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0104, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0104, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O'], ['CG', 'CE2', 'CD2', 'HD2'], ['CD2', 'CZ', 'CE2', 'HE2'], ['CE1', 'CE2', 'CZ', 'HZ'], ['CD1', 'CZ', 'CE1', 'HE1'], ['CG', 'CE1', 'CD1', 'HD1'], ['CD1', 'CD2', 'CG', 'CB']],
	"INTX,KFORM":['INT', '1'],
	"HD2":{'torsion': 180.0, 'tree': 'E', 'NC': 18, 'NB': 20, 'NA': 22, 'I': 23, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1374, 'type': 'HA'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1921, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1921, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1921, 'type': 'H'},
	"HD1":{'torsion': 0.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1374, 'type': 'HA'},
	"HE1":{'torsion': 180.0, 'tree': 'E', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1433, 'type': 'HA'},
	"HE2":{'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 18, 'NA': 20, 'I': 21, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1433, 'type': 'HA'},
	"CD2":{'torsion': 0.0, 'tree': 'S', 'NC': 16, 'NB': 18, 'NA': 20, 'I': 22, 'angle': 120.0, 'blen': 1.4, 'charge': -0.1391, 'type': 'CA'},
	"NAMRES":'PHENYLALANINE',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'CD1', 'HD1', 'CE1', 'HE1', 'CZ', 'HZ', 'CE2', 'HE2', 'CD2', 'HD2', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"CE1":{'torsion': 180.0, 'tree': 'B', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 120.0, 'blen': 1.4, 'charge': -0.1602, 'type': 'CA'},
	"CD1":{'torsion': 180.0, 'tree': 'B', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 120.0, 'blen': 1.4, 'charge': -0.1392, 'type': 'CA'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1041, 'type': 'HP'},
	"CZ":{'torsion': 0.0, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 18, 'angle': 120.0, 'blen': 1.4, 'charge': -0.1208, 'type': 'CA'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1737, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 24, 'I': 25, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': 'S', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 115.0, 'blen': 1.51, 'charge': 0.0031, 'type': 'CA'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0733, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.033, 'type': 'CT'},
	"CE2":{'torsion': 0.0, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 18, 'I': 20, 'angle': 120.0, 'blen': 1.4, 'charge': -0.1603, 'type': 'CA'},
	"loopList":[['CG', 'CD2']],
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 24, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
	"HZ":{'torsion': 180.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 18, 'I': 19, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1329, 'type': 'HA'},
},
"CYX": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.068, 'type': 'H1'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.068, 'type': 'H1'},
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'SG', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"SG":{'torsion': 180.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 116.0, 'blen': 1.81, 'charge': -0.0984, 'type': 'S'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 14, 'I': 15, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0922, 'type': 'HP'},
	"impropTors":[['CA', '+M', 'C', 'O']],
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1815, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.2069, 'type': 'N3'},
	"INTX,KFORM":['INT', '1'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1815, 'type': 'H'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.1055, 'type': 'CT'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1815, 'type': 'H'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': -0.0277, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 14, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
	"NAMRES":'CYSTINE(S-S BRIDGE)',
},
"PRO": {	"HB2":{'torsion': 256.3, 'tree': 'E', 'NC': 7, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1, 'type': 'HC'},
	"HB3":{'torsion': 136.3, 'tree': 'E', 'NC': 7, 'NB': 10, 'NA': 13, 'I': 15, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O']],
	"INTX,KFORM":['INT', '1'],
	"HG3":{'torsion': 98.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1, 'type': 'HC'},
	"HG2":{'torsion': 218.0, 'tree': 'E', 'NC': 4, 'NB': 7, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1, 'type': 'HC'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.312, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 60.0, 'blen': 1.01, 'charge': 0.312, 'type': 'H'},
	"loopList":[['CB', 'CA']],
	"HD2":{'torsion': 80.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 8, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1, 'type': 'HP'},
	"HD3":{'torsion': 320.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1, 'type': 'HP'},
	"NAMRES":'PROLINE',
	"atNameList":['N', 'H2', 'H3', 'CD', 'HD2', 'HD3', 'CG', 'HG2', 'HG3', 'CB', 'HB2', 'HB3', 'CA', 'HA', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HA":{'torsion': 60.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 16, 'I': 17, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': -0.202, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 16, 'NA': 18, 'I': 19, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5, 'type': 'O'},
	"CG":{'torsion': 200.1, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 7, 'I': 10, 'angle': 103.2, 'blen': 1.5, 'charge': -0.121, 'type': 'CT'},
	"CA":{'torsion': 175.2, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 16, 'angle': 120.6, 'blen': 1.451, 'charge': 0.1, 'type': 'CT'},
	"CB":{'torsion': 338.3, 'tree': 'B', 'NC': 4, 'NB': 7, 'NA': 10, 'I': 13, 'angle': 106.0, 'blen': 1.51, 'charge': -0.115, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 300.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 16, 'I': 18, 'angle': 109.5, 'blen': 1.522, 'charge': 0.526, 'type': 'C'},
	"CD":{'torsion': 356.1, 'tree': '3', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 126.1, 'blen': 1.458, 'charge': -0.012, 'type': 'CT'},
},
"LYS": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0283, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0283, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O']],
	"HZ2":{'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 19, 'NA': 22, 'I': 24, 'angle': 109.47, 'blen': 1.01, 'charge': 0.3382, 'type': 'H'},
	"HZ3":{'torsion': 300.0, 'tree': 'E', 'NC': 16, 'NB': 19, 'NA': 22, 'I': 25, 'angle': 109.47, 'blen': 1.01, 'charge': 0.3382, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2165, 'type': 'H'},
	"HZ1":{'torsion': 60.0, 'tree': 'E', 'NC': 16, 'NB': 19, 'NA': 22, 'I': 23, 'angle': 109.47, 'blen': 1.01, 'charge': 0.3382, 'type': 'H'},
	"NZ":{'torsion': 180.0, 'tree': '3', 'NC': 13, 'NB': 16, 'NA': 19, 'I': 22, 'angle': 109.47, 'blen': 1.47, 'charge': -0.3764, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 26, 'I': 27, 'angle': 120.5, 'blen': 1.229, 'charge': -0.6013, 'type': 'O'},
	"INTX,KFORM":['INT', '1'],
	"HG3":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 15, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0121, 'type': 'HC'},
	"HG2":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0121, 'type': 'HC'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.2165, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.0966, 'type': 'N3'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2165, 'type': 'H'},
	"HE3":{'torsion': 60.0, 'tree': 'E', 'NC': 13, 'NB': 16, 'NA': 19, 'I': 21, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1171, 'type': 'HP'},
	"HE2":{'torsion': 300.0, 'tree': 'E', 'NC': 13, 'NB': 16, 'NA': 19, 'I': 20, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1171, 'type': 'HP'},
	"HD2":{'torsion': 300.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 17, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0633, 'type': 'HC'},
	"HD3":{'torsion': 60.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 18, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0633, 'type': 'HC'},
	"NAMRES":'LYSINE',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'HG2', 'HG3', 'CD', 'HD2', 'HD3', 'CE', 'HE2', 'HE3', 'NZ', 'HZ1', 'HZ2', 'HZ3', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.118, 'type': 'HP'},
	"CD":{'torsion': 180.0, 'tree': '3', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 16, 'angle': 109.47, 'blen': 1.525, 'charge': -0.0608, 'type': 'CT'},
	"CE":{'torsion': 180.0, 'tree': '3', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 19, 'angle': 109.47, 'blen': 1.525, 'charge': -0.0181, 'type': 'CT'},
	"CG":{'torsion': 180.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.47, 'blen': 1.525, 'charge': -0.0048, 'type': 'CT'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': -0.0015, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0212, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 26, 'angle': 111.1, 'blen': 1.522, 'charge': 0.7214, 'type': 'C'},
},
"NAMDBF":'db94.dat',
"SER": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0273, 'type': 'H1'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0273, 'type': 'H1'},
	"HG":{'torsion': 180.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 109.47, 'blen': 0.96, 'charge': 0.4239, 'type': 'HO'},
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'OG', 'HG', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 15, 'I': 16, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5722, 'type': 'O'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0782, 'type': 'HP'},
	"impropTors":[['CA', '+M', 'C', 'O']],
	"OG":{'torsion': 180.0, 'tree': 'S', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.47, 'blen': 1.43, 'charge': -0.6714, 'type': 'OH'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1898, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1849, 'type': 'N3'},
	"INTX,KFORM":['INT', '1'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1898, 'type': 'H'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0567, 'type': 'CT'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1898, 'type': 'H'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.2596, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 15, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6163, 'type': 'C'},
	"NAMRES":'SERINE',
},
"ASP": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': -0.0169, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': -0.0169, 'type': 'HC'},
	"OD1":{'torsion': 90.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 117.2, 'blen': 1.26, 'charge': -0.8084, 'type': 'O2'},
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'OD1', 'OD2', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 16, 'I': 17, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5889, 'type': 'O'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1141, 'type': 'HP'},
	"impropTors":[['CA', '+M', 'C', 'O'], ['CB', 'OD1', 'CG', 'OD2']],
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.22, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.0782, 'type': 'N3'},
	"INTX,KFORM":['INT', '1'],
	"CG":{'torsion': 180.0, 'tree': 'B', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.47, 'blen': 1.527, 'charge': 0.8194, 'type': 'C'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.22, 'type': 'H'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0292, 'type': 'CT'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.22, 'type': 'H'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"OD2":{'torsion': 270.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 15, 'angle': 117.2, 'blen': 1.26, 'charge': -0.8084, 'type': 'O2'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': -0.0235, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 16, 'angle': 111.1, 'blen': 1.522, 'charge': 0.5621, 'type': 'C'},
	"NAMRES":'ASPARTIC ACID',
},
"GLN": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.005, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.005, 'type': 'HC'},
	"NE2":{'torsion': 180.0, 'tree': 'B', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 18, 'angle': 116.6, 'blen': 1.335, 'charge': -1.0031, 'type': 'N'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O'], ['CG', 'NE2', 'CD', 'OE1'], ['CD', 'HE21', 'NE2', 'HE22']],
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1996, 'type': 'H'},
	"INTX,KFORM":['INT', '1'],
	"HG3":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 15, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0331, 'type': 'HC'},
	"HG2":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0331, 'type': 'HC'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1996, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1493, 'type': 'N3'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1996, 'type': 'H'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0536, 'type': 'CT'},
	"NAMRES":'GLUTAMINE',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'HG2', 'HG3', 'CD', 'OE1', 'NE2', 'HE21', 'HE22', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HE21":{'torsion': 180.0, 'tree': 'E', 'NC': 13, 'NB': 16, 'NA': 18, 'I': 19, 'angle': 119.8, 'blen': 1.01, 'charge': 0.4429, 'type': 'H'},
	"HE22":{'torsion': 0.0, 'tree': 'E', 'NC': 13, 'NB': 16, 'NA': 18, 'I': 20, 'angle': 119.8, 'blen': 1.01, 'charge': 0.4429, 'type': 'H'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1015, 'type': 'HP'},
	"CD":{'torsion': 180.0, 'tree': 'B', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 16, 'angle': 111.1, 'blen': 1.522, 'charge': 0.7354, 'type': 'C'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 21, 'I': 22, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.47, 'blen': 1.525, 'charge': -0.0903, 'type': 'CT'},
	"OE1":{'torsion': 0.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 17, 'angle': 120.5, 'blen': 1.229, 'charge': -0.6133, 'type': 'O'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0651, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 21, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
},
"GLU": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': -0.0232, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': -0.0232, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O'], ['CG', 'OE1', 'CD', 'OE2']],
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2391, 'type': 'H'},
	"INTX,KFORM":['INT', '1'],
	"HG3":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 15, 'angle': 109.5, 'blen': 1.09, 'charge': -0.0315, 'type': 'HC'},
	"HG2":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': -0.0315, 'type': 'HC'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.2391, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.0017, 'type': 'N3'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2391, 'type': 'H'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0588, 'type': 'CT'},
	"OE2":{'torsion': 270.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 18, 'angle': 117.2, 'blen': 1.26, 'charge': -0.8189, 'type': 'O2'},
	"NAMRES":'GLUTAMIC ACID',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'HG2', 'HG3', 'CD', 'OE1', 'OE2', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1202, 'type': 'HP'},
	"CD":{'torsion': 180.0, 'tree': 'B', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 16, 'angle': 109.47, 'blen': 1.527, 'charge': 0.8087, 'type': 'C'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 19, 'I': 20, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5889, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 109.47, 'blen': 1.51, 'charge': -0.0236, 'type': 'CT'},
	"OE1":{'torsion': 90.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 16, 'I': 17, 'angle': 117.2, 'blen': 1.26, 'charge': -0.8189, 'type': 'O2'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0909, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 19, 'angle': 111.1, 'blen': 1.522, 'charge': 0.5621, 'type': 'C'},
},
"TRP": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0222, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0222, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"HZ2":{'torsion': 0.0, 'tree': 'E', 'NC': 16, 'NB': 18, 'NA': 19, 'I': 20, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1589, 'type': 'HA'},
	"HZ3":{'torsion': 180.0, 'tree': 'E', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 24, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1458, 'type': 'HA'},
	"impropTors":[['CA', '+M', 'C', 'O'], ['CD1', 'CE2', 'NE1', 'HE1'], ['CE2', 'CH2', 'CZ2', 'HZ2'], ['CZ2', 'CZ3', 'CH2', 'HH2'], ['CH2', 'CE3', 'CZ3', 'HZ3'], ['CZ3', 'CD2', 'CE3', 'HE3'], ['CG', 'NE1', 'CD1', 'HD1'], ['CD1', 'CD2', 'CG', 'CB']],
	"CH2":{'torsion': 180.0, 'tree': 'B', 'NC': 16, 'NB': 18, 'NA': 19, 'I': 21, 'angle': 116.0, 'blen': 1.39, 'charge': -0.108, 'type': 'CA'},
	"CZ3":{'torsion': 0.0, 'tree': 'B', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 23, 'angle': 121.0, 'blen': 1.35, 'charge': -0.2034, 'type': 'CA'},
	"NE1":{'torsion': 180.0, 'tree': 'B', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 107.0, 'blen': 1.43, 'charge': -0.3444, 'type': 'NA'},
	"INTX,KFORM":['INT', '1'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1888, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1888, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1888, 'type': 'H'},
	"HE3":{'torsion': 180.0, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 26, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1646, 'type': 'HA'},
	"HD1":{'torsion': 0.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 120.0, 'blen': 1.09, 'charge': 0.2195, 'type': 'H4'},
	"HE1":{'torsion': 180.0, 'tree': 'E', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 125.5, 'blen': 1.01, 'charge': 0.3412, 'type': 'H'},
	"NAMRES":'TRYPTOPHAN',
	"CD1":{'torsion': 180.0, 'tree': 'B', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 127.0, 'blen': 1.34, 'charge': -0.1788, 'type': 'CW'},
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'CD1', 'HD1', 'NE1', 'HE1', 'CE2', 'CZ2', 'HZ2', 'CH2', 'HH2', 'CZ3', 'HZ3', 'CE3', 'HE3', 'CD2', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"CD2":{'torsion': 0.0, 'tree': 'E', 'NC': 21, 'NB': 23, 'NA': 25, 'I': 27, 'angle': 117.0, 'blen': 1.4, 'charge': 0.1132, 'type': 'CB'},
	"CE2":{'torsion': 0.0, 'tree': 'S', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 18, 'angle': 109.0, 'blen': 1.31, 'charge': 0.1575, 'type': 'CN'},
	"CE3":{'torsion': 0.0, 'tree': 'B', 'NC': 19, 'NB': 21, 'NA': 23, 'I': 25, 'angle': 122.0, 'blen': 1.41, 'charge': -0.2265, 'type': 'CA'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1162, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1913, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 28, 'I': 29, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': 'S', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 115.0, 'blen': 1.51, 'charge': -0.1654, 'type': 'C*'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0421, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0543, 'type': 'CT'},
	"CZ2":{'torsion': 180.0, 'tree': 'B', 'NC': 14, 'NB': 16, 'NA': 18, 'I': 19, 'angle': 128.0, 'blen': 1.4, 'charge': -0.271, 'type': 'CA'},
	"loopList":[['CG', 'CD2'], ['CE2', 'CD2']],
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 28, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
	"HH2":{'torsion': 180.0, 'tree': 'E', 'NC': 18, 'NB': 19, 'NA': 21, 'I': 22, 'angle': 120.0, 'blen': 1.09, 'charge': 0.1411, 'type': 'HA'},
},
"GLY": {	"HA3":{'torsion': 60.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0895, 'type': 'HP'},
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA2', 'HA3', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HA2":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0895, 'type': 'HP'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 11, 'I': 12, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5722, 'type': 'O'},
	"impropTors":[['CA', '+M', 'C', 'O']],
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1642, 'type': 'H'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.2943, 'type': 'N3'},
	"INTX,KFORM":['INT', '1'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1642, 'type': 'H'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': -0.01, 'type': 'CT'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1642, 'type': 'H'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 11, 'angle': 110.4, 'blen': 1.522, 'charge': 0.6163, 'type': 'C'},
	"NAMRES":'GLYCINE',
},
"THR": {	"HG22":{'torsion': 180.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 12, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0627, 'type': 'HC'},
	"HG23":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 12, 'I': 15, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0627, 'type': 'HC'},
	"HG21":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0627, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1934, 'type': 'H'},
	"HG1":{'torsion': 180.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 16, 'I': 17, 'angle': 109.47, 'blen': 0.96, 'charge': 0.407, 'type': 'HO'},
	"INTX,KFORM":['INT', '1'],
	"CG2":{'torsion': 300.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.47, 'blen': 1.525, 'charge': -0.2554, 'type': 'CT'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1934, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1934, 'type': 'H'},
	"NAMRES":'THREONINE',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB', 'CG2', 'HG21', 'HG22', 'HG23', 'OG1', 'HG1', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HB":{'torsion': 180.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': -0.0323, 'type': 'H1'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1087, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.1812, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 18, 'I': 19, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5722, 'type': 'O'},
	"OG1":{'torsion': 60.0, 'tree': 'S', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 16, 'angle': 109.47, 'blen': 1.43, 'charge': -0.6764, 'type': 'OH'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0034, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.4514, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 18, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6163, 'type': 'C'},
	"impropTors":[['CA', '+M', 'C', 'O']],
},
"HIP": {	"HB2":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0531, 'type': 'HC'},
	"HB3":{'torsion': 60.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0531, 'type': 'HC'},
	"NE2":{'torsion': 0.0, 'tree': 'B', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 18, 'angle': 109.0, 'blen': 1.31, 'charge': -0.1739, 'type': 'NA'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"ND1":{'torsion': 180.0, 'tree': 'B', 'NC': 8, 'NB': 10, 'NA': 13, 'I': 14, 'angle': 122.0, 'blen': 1.39, 'charge': -0.151, 'type': 'NA'},
	"impropTors":[['CA', '+M', 'C', 'O'], ['CG', 'CE1', 'ND1', 'HD1'], ['CE1', 'CD2', 'NE2', 'HE2'], ['CG', 'NE2', 'CD2', 'HD2'], ['ND1', 'NE2', 'CE1', 'HE1'], ['ND1', 'CD2', 'CG', 'CB']],
	"INTX,KFORM":['INT', '1'],
	"HD2":{'torsion': 180.0, 'tree': 'E', 'NC': 16, 'NB': 18, 'NA': 20, 'I': 21, 'angle': 120.0, 'blen': 1.09, 'charge': 0.2495, 'type': 'H4'},
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.1704, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1704, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.1704, 'type': 'H'},
	"HD1":{'torsion': 0.0, 'tree': 'E', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 15, 'angle': 126.0, 'blen': 1.01, 'charge': 0.3821, 'type': 'H'},
	"HE1":{'torsion': 180.0, 'tree': 'E', 'NC': 13, 'NB': 14, 'NA': 16, 'I': 17, 'angle': 120.0, 'blen': 1.09, 'charge': 0.2645, 'type': 'H5'},
	"HE2":{'torsion': 180.0, 'tree': 'E', 'NC': 14, 'NB': 16, 'NA': 18, 'I': 19, 'angle': 125.0, 'blen': 1.01, 'charge': 0.3921, 'type': 'H'},
	"CD2":{'torsion': 0.0, 'tree': 'S', 'NC': 14, 'NB': 16, 'NA': 18, 'I': 20, 'angle': 110.0, 'blen': 1.36, 'charge': -0.1433, 'type': 'CW'},
	"NAMRES":'HISTIDINE PLUS',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB2', 'HB3', 'CG', 'ND1', 'HD1', 'CE1', 'HE1', 'NE2', 'HE2', 'CD2', 'HD2', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"CE1":{'torsion': 180.0, 'tree': 'B', 'NC': 10, 'NB': 13, 'NA': 14, 'I': 16, 'angle': 108.0, 'blen': 1.32, 'charge': -0.0011, 'type': 'CR'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1047, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.256, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 22, 'I': 23, 'angle': 120.5, 'blen': 1.229, 'charge': -0.6013, 'type': 'O'},
	"CG":{'torsion': 180.0, 'tree': 'S', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 13, 'angle': 115.0, 'blen': 1.51, 'charge': -0.0236, 'type': 'CC'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0581, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.0484, 'type': 'CT'},
	"loopList":[['CG', 'CD2']],
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 22, 'angle': 111.1, 'blen': 1.522, 'charge': 0.7214, 'type': 'C'},
},
"VAL": {	"HG22":{'torsion': 180.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 16, 'I': 18, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0735, 'type': 'HC'},
	"HG23":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 16, 'I': 19, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0735, 'type': 'HC'},
	"HG21":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 16, 'I': 17, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0735, 'type': 'HC'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"impropTors":[['CA', '+M', 'C', 'O']],
	"HG13":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 12, 'I': 15, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0735, 'type': 'HC'},
	"HG12":{'torsion': 180.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 12, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0735, 'type': 'HC'},
	"HG11":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0735, 'type': 'HC'},
	"INTX,KFORM":['INT', '1'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.2272, 'type': 'H'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2272, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2272, 'type': 'H'},
	"CG1":{'torsion': 60.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.47, 'blen': 1.525, 'charge': -0.3129, 'type': 'CT'},
	"NAMRES":'VALINE',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB', 'CG1', 'HG11', 'HG12', 'HG13', 'CG2', 'HG21', 'HG22', 'HG23', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HB":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': -0.0221, 'type': 'HC'},
	"CG2":{'torsion': 180.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 16, 'angle': 109.47, 'blen': 1.525, 'charge': -0.3129, 'type': 'CT'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1093, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.0577, 'type': 'N3'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 20, 'I': 21, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5722, 'type': 'O'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': -0.0054, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 111.1, 'blen': 1.525, 'charge': 0.3196, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 20, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6163, 'type': 'C'},
},
"ILE": {	"HG22":{'torsion': 180.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 12, 'I': 14, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0947, 'type': 'HC'},
	"HG23":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 12, 'I': 15, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0947, 'type': 'HC'},
	"HG21":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 12, 'I': 13, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0947, 'type': 'HC'},
	"O":{'torsion': 0.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 23, 'I': 24, 'angle': 120.5, 'blen': 1.229, 'charge': -0.5713, 'type': 'O'},
	"IFIXC,IOMIT,ISYMDU,IPOS":['CORR', 'NOMI', 'DU', 'BEG'],
	"H1":{'torsion': 0.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 5, 'angle': 130.0, 'blen': 1.01, 'charge': 0.2329, 'type': 'H'},
	"HG13":{'torsion': 300.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 16, 'I': 18, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0201, 'type': 'HC'},
	"HG12":{'torsion': 60.0, 'tree': 'E', 'NC': 8, 'NB': 10, 'NA': 16, 'I': 17, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0201, 'type': 'HC'},
	"INTX,KFORM":['INT', '1'],
	"CG2":{'torsion': 60.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 12, 'angle': 109.47, 'blen': 1.525, 'charge': -0.372, 'type': 'CT'},
	"H3":{'torsion': -90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 7, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2329, 'type': 'H'},
	"H2":{'torsion': 90.0, 'tree': 'E', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 6, 'angle': 60.0, 'blen': 1.01, 'charge': 0.2329, 'type': 'H'},
	"CG1":{'torsion': 180.0, 'tree': '3', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 16, 'angle': 109.47, 'blen': 1.525, 'charge': -0.0387, 'type': 'CT'},
	"NAMRES":'ISOLEUCINE',
	"atNameList":['N', 'H1', 'H2', 'H3', 'CA', 'HA', 'CB', 'HB', 'CG2', 'HG21', 'HG22', 'HG23', 'CG1', 'HG12', 'HG13', 'CD1', 'HD11', 'HD12', 'HD13', 'C', 'O'],
	"DUMM":[['1', 'DUMM', 'DU', 'M', '0', '-1', '-2', '0.000', '0.000', '0.000', '0.00000'], ['2', 'DUMM', 'DU', 'M', '1', '0', '-1', '1.449', '0.000', '0.000', '0.00000'], ['3', 'DUMM', 'DU', 'M', '2', '1', '0', '1.522', '111.100', '0.000', '0.00000']],
	"HD11":{'torsion': 60.0, 'tree': 'E', 'NC': 10, 'NB': 16, 'NA': 19, 'I': 20, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0226, 'type': 'HC'},
	"HD12":{'torsion': 180.0, 'tree': 'E', 'NC': 10, 'NB': 16, 'NA': 19, 'I': 21, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0226, 'type': 'HC'},
	"HB":{'torsion': 300.0, 'tree': 'E', 'NC': 4, 'NB': 8, 'NA': 10, 'I': 11, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0213, 'type': 'HC'},
	"CD1":{'torsion': 180.0, 'tree': '3', 'NC': 8, 'NB': 10, 'NA': 16, 'I': 19, 'angle': 109.47, 'blen': 1.525, 'charge': -0.0908, 'type': 'CT'},
	"HA":{'torsion': 300.0, 'tree': 'E', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 9, 'angle': 109.5, 'blen': 1.09, 'charge': 0.1031, 'type': 'HP'},
	"N":{'torsion': 180.0, 'tree': 'M', 'NC': 1, 'NB': 2, 'NA': 3, 'I': 4, 'angle': 116.6, 'blen': 1.335, 'charge': 0.0311, 'type': 'N3'},
	"HD13":{'torsion': 300.0, 'tree': 'E', 'NC': 10, 'NB': 16, 'NA': 19, 'I': 22, 'angle': 109.5, 'blen': 1.09, 'charge': 0.0226, 'type': 'HC'},
	"CA":{'torsion': 180.0, 'tree': 'M', 'NC': 2, 'NB': 3, 'NA': 4, 'I': 8, 'angle': 121.9, 'blen': 1.449, 'charge': 0.0257, 'type': 'CT'},
	"CB":{'torsion': 60.0, 'tree': '3', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 10, 'angle': 109.47, 'blen': 1.525, 'charge': 0.1885, 'type': 'CT'},
	"CUT":['0.00000'],
	"C":{'torsion': 180.0, 'tree': 'M', 'NC': 3, 'NB': 4, 'NA': 8, 'I': 23, 'angle': 111.1, 'blen': 1.522, 'charge': 0.6123, 'type': 'C'},
	"impropTors":[['CA', '+M', 'C', 'O']],
},
"filename":'all_aminont94.in',
}